BDBM50156311 CHEMBL187620::N-arylpiperazine derivative

SMILES: COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1cccc(NC(NCCNC2CCN(CC2)c2ccccc2OC)=NC#N)c1

InChI Key: InChIKey=UOTOARZOADGZAP-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50156311   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuropeptide Y receptor type 1 (Homo sapiens (Human))	BDBM50156311 (CHEMBL187620 | N-arylpiperazine derivative) Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1cccc(NC(NCCNC2CCN(CC2)c2ccccc2OC)=NC#N)c1 |w:41.44,c:13,t:10| Show InChI InChI=1S/C33H41N7O5/c1-21-28(31(41)44-4)30(29(22(2)38-21)32(42)45-5)23-9-8-10-25(19-23)39-33(37-20-34)36-16-15-35-24-13-17-40(18-14-24)26-11-6-7-12-27(26)43-3/h6-12,19,24,28,30,35H,13-18H2,1-5H3,(H2,36,37,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Antagonist activity towards Neuropeptide Y receptor type 1				Bioorg Med Chem Lett 14: 5975-8 (2004) Article DOI: 10.1016/j.bmcl.2004.10.005 BindingDB Entry DOI: 10.7270/Q2765DTG
					More data for this Ligand-Target Pair
Neuropeptide Y receptor type 1 (Homo sapiens (Human))	BDBM50156311 (CHEMBL187620 | N-arylpiperazine derivative) Show SMILES COC(=O)C1C(C(C(=O)OC)=C(C)N=C1C)c1cccc(NC(NCCNC2CCN(CC2)c2ccccc2OC)=NC#N)c1 |w:41.44,c:13,t:10| Show InChI InChI=1S/C33H41N7O5/c1-21-28(31(41)44-4)30(29(22(2)38-21)32(42)45-5)23-9-8-10-25(19-23)39-33(37-20-34)36-16-15-35-24-13-17-40(18-14-24)26-11-6-7-12-27(26)43-3/h6-12,19,24,28,30,35H,13-18H2,1-5H3,(H2,36,37,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-PYY to membranes of SK-N-MC cells expressing the human Y1 receptors				Bioorg Med Chem Lett 14: 5975-8 (2004) Article DOI: 10.1016/j.bmcl.2004.10.005 BindingDB Entry DOI: 10.7270/Q2765DTG
					More data for this Ligand-Target Pair